N-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine

C19H17N3O2 — CID 139921584

IUPACN-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine
SMILESCOc1cc2nccc(Nc3cccc4[nH]ccc34)c2cc1OC
InChIInChI=1S/C19H17N3O2/c1-23-18-10-13-16(7-9-21-17(13)11-19(18)24-2)22-15-5-3-4-14-12(15)6-8-20-14/h3-11,20H,1-2H3,(H,21,22)
InChIKeyQPBFSYSGAVEEOG-UHFFFAOYSA-N
MW319.36 g/mol
LogP4.48
Rot. Bonds4

About N-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine

N-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine (PubChem CID 139921584) has the molecular formula C19H17N3O2 and a molecular weight of 319.36 g/mol. Its IUPAC name is N-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine.

Molecular Properties

Compound NameN-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine
PubChem CID139921584
Molecular FormulaC19H17N3O2
Molecular Weight319.36 g/mol
Exact Mass319.13
IUPAC NameN-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine
SMILESCOc1cc2nccc(Nc3cccc4[nH]ccc34)c2cc1OC
InChIInChI=1S/C19H17N3O2/c1-23-18-10-13-16(7-9-21-17(13)11-19(18)24-2)22-15-5-3-4-14-12(15)6-8-20-14/h3-11,20H,1-2H3,(H,21,22)
InChIKeyQPBFSYSGAVEEOG-UHFFFAOYSA-N
XLogP4.48
TPSA59.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 54.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine
CID 53264717
1-[2-[(6,7-dimethoxyquinolin-4-yl)amino]phenyl]ethanone
CID 53264744
6,7-dimethoxy-N-methylquinolin-4-amine
CID 62190466
N-(4-chloro-2,5-dimethoxyphenyl)-6,7-dimethoxyquinolin-4-amine
CID 53264749
3-[(6,7-dimethoxyquinolin-4-yl)amino]phenol;hydrochloride
CID 22646651
2-(2,3-dimethoxyphenyl)-N-(4-methyl-1H-indol-5-yl)furo[3,2-b]pyridin-7-amine
CID 66779317
6,7-dimethoxy-N-(4-naphthalen-2-yloxyphenyl)quinolin-4-amine
CID 166515203
N-[2-ethyl-3-[(2H-tetrazol-5-ylamino)methyl]phenyl]-6,7-dimethoxyquinolin-4-amine
CID 141124589
N-(1H-indol-4-yl)-5-(3,4,5-trimethoxyphenyl)-[1,2,4]triazolo[1,5-c]pyrimidin-2-amine
CID 169450726
methane;4,6,7-trimethoxyquinoline
CID 157066291
6,7-dimethoxy-N-(3-phenoxyphenyl)quinolin-4-amine;N-(3-phenoxyphenyl)quinolin-4-amine;dihydrochloride
CID 67730198
2-[(6,7-dimethoxyquinolin-4-yl)amino]ethanol
CID 159856965

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine?
The IUPAC name of N-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine (CID 139921584) is N-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine.
What is the SMILES notation for N-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine?
The canonical SMILES for N-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine is COc1cc2nccc(Nc3cccc4[nH]ccc34)c2cc1OC.
What is the InChIKey of N-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine?
The InChIKey is QPBFSYSGAVEEOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O2/c1-23-18-10-13-16(7-9-21-17(13)11-19(18)24-2)22-15-5-3-4-14-12(15)6-8-20-14/h3-11,20H,1-2H3,(H,21,22).
What are the key properties of N-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine?
N-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine has a molecular weight of 319.36 g/mol, XLogP of 4.48, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine is sourced from PubChem (CID 139921584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).